1-(2-nitro-5-oxidanyl-phenyl)propan-1-one

Systemtic Name: 1-(2-nitro-5-oxidanyl-phenyl)propan-1-one Openeye Name: 1-(5-hydroxy-2-nitro-phenyl)propan-1-one CAS Name: 1-(5-hydroxy-2-nitrophenyl)-1-propanone IUPAC Name: 1-(5-hydroxy-2-nitrophenyl)propan-1-one Traditional Name: 1-(5-hydroxy-2-nitro-phenyl)propan-1-one Formula: C9H9NO4 MolecularWeight: 195.17206

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C=CC(=C1)O)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)C1=C(C=CC(=C1)O)[N+](=O)[O-]

InChI

InChI=1S/C9H9NO4/c1-2-9(12)7-5-6(11)3-4-8(7)10(13)14/h3-5,11H,2H2,1H3